{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2435648 -1.2045409 -1.2323974 ] [ -9.9638211 -1.1118432 7.7343016 ] [ -2.1452793 2.4423519 -1.2788742 ] [ 1.2202526 -6.7903827 -2.7950777 ] [ 3.5279245 -3.4648136 2.0529927 ] [ 8.1084737 7.553761 -6.7936957 ] [ 1.4960144 2.5754674 2.3127508 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.594587069809828e-09 -1.929887268777391e-09 -1.974518301814706e-09 ] [ -1.596380122025374e-08 -1.781369181035459e-09 1.239171720173603e-08 ] [ -3.437116339546189e-09 3.913079113946459e-09 -2.048982344184303e-09 ] [ 1.955060187190414e-09 -1.087939240822478e-08 -4.478208144259437e-09 ] [ 5.65235815384753e-09 -5.551243345349883e-09 3.289256906613068e-09 ] [ 1.299120699251167e-08 1.210245927331083e-08 -1.088470041936949e-08 ] [ 2.396879296060139e-09 4.126353655912562e-09 3.705435261496497e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.865781 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.862413663053285e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.596287 2.4542346 1.1033217 ] [ 1.7616391 2.3782129 3.7345285 ] [ 1.7628113 4.6330526 2.3662944 ] [ 3.1919729 0.8127783 2.1661 ] [ 4.3446615 1.9771065 4.0859255 ] [ 3.981213 3.307932 1.8379869 ] [ 3.4614032 4.3381721 4.2096399 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.596287e-10 2.4542346e-10 1.1033217e-10 ] [ 1.7616391e-10 2.3782129e-10 3.7345285e-10 ] [ 1.7628113e-10 4.6330526e-10 2.3662944e-10 ] [ 3.1919729e-10 8.127783e-11 2.1661e-10 ] [ 4.3446615e-10 1.9771065e-10 4.0859255e-10 ] [ 3.981213e-10 3.307932e-10 1.8379869e-10 ] [ 3.4614032e-10 4.3381721e-10 4.2096399e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.74e-05 -6.5e-06 1.28e-05 ] [ 9.06e-05 4e-06 -8.2e-05 ] [ -1.31e-05 1.82e-05 2e-06 ] [ -2.32e-05 9.8e-06 1.41e-05 ] [ -1.32e-05 1.21e-05 -3.33e-05 ] [ -6.78e-05 -6.32e-05 5.17e-05 ] [ -8e-07 2.55e-05 3.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.389963940992e-14 -1.04141480352e-14 2.050786074624e-14 ] [ 1.4515720184448e-13 6.4087064832e-15 -1.313784829056e-13 ] [ -2.098851373248e-14 2.915961449856e-14 3.2043532416e-15 ] [ -3.717049760256e-14 1.570133088384e-14 2.259069035328e-14 ] [ -2.114873139456e-14 1.938633711168e-14 -5.335248147264001e-14 ] [ -1.0862757489024e-13 -1.0125756243456e-13 8.283253129536002e-14 ] [ -1.28174129664e-15 4.08555038304e-14 5.559552874176001e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.454184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.917992188554143e-18 } }